Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester
TL;DR: Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester (CAS 144298-64-6) is a chemical compound with molecular formula C11H13F2NO2 and molecular weight 229.09143 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-(3,4-difluorophenyl)carbamate
Also Known As: tert-butyl N-(3,4-difluorophenyl)carbamate, tert-butyl (3,4-difluorophenyl)carbamate, tert-Butyl 3,4-difluorophenylcarbamate, 8-Dodecenal, (E)-, N-Boc-3,4-difluoroaniline
Technical Specifications
| Molecular Formula | C11H13F2NO2 |
| Molecular Weight | 229.09143 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 229.09143 Da |
| Heavy Atoms | 16 |
| Complexity | 253.0 |
| SMILES | CC(C)(C)OC(=O)NC1=CC(=C(C=C1)F)F |
| InChIKey | WIUZQRIAAKGULG-UHFFFAOYSA-N |
Chemical Property Profile of Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester
Property Insights of Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester. With a topological polar surface area (TPSA) of 38.3 Ų, Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester?
The CAS number of Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester is 144298-64-6.
What is the molecular formula of Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester?
The molecular formula of Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester is C11H13F2NO2.
What is the molecular weight of Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester?
The molecular weight of Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester is 229.09143 g/mol.
Where can I buy Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester?
You can request a quote for Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester?
Yes, CoreyChem provides custom synthesis services for Carbamic acid, (3,4-difluorophenyl)-, 1,1-dimethylethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.